Basic information
- CAS
78092-65-6- Standard SMILES
OCCSCc1ccncc1- InChIKey
OYJOLTPPSDAGJC-UHFFFAOYSA-N- Molecular formula
- C8H11NOS
- Average molar mass
- 169.25 g/mol
- Monoisotopic mass
- 169.05613497
Overview
Ristianol is a small molecule drug. Ristianol has a monoisotopic molecular weight of 169.06 Da.
Names & identifiers
- Preferred name
- Ristianol
- IUPAC
- 2-(pyridin-4-ylmethylsulfanyl)ethanol
- English name
- Ristianol
- Molecular formula
- C8H11NOS
- Molecular weight
- 169.24
Names & synonyms
RistianolRistianolum78092-65-6Ristianol [INN:BAN]2-((4-Pyridylmethyl)thio)ethanolUNII-8KR602T33Q8KR602T33QEthanol, 2-((4-pyridylmethyl)thio)-RISTIANOL [INN]DTXSID002287272-(4-PYRIDYLMETHYL)THIOETHANOLETHANOL, 2-((4-PYRIDINYLMETHYL)THIO)-
Show more names
2-[(Pyridin-4-ylmethyl)thio]ethanolEthanol, 2-[(4-pyridinylmethyl)thio]-
RefChem:179496DTXCID501512182-(pyridin-4-ylmethylsulfanyl)ethanol2-{[(pyridin-4-yl)methyl]sulfanyl}ethan-1-olCHEMBL2111037SCHEMBL10352649OYJOLTPPSDAGJC-UHFFFAOYSA-N4-(2-hydroxyethylthiomethyl)pyridine
Database identifiers
- CAS
78092-65-6- PubChem CID
- 54050
- DTXSID
DTXSID00228727- ChEMBL
CHEMBL2111037- UNII
- 8KR602T33Q
- Nikkaji
- J23.267J
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 58.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 94.1
Physicochemical properties
- FDA UNII
- 8 KR602T33Q · 8KR602T33Q
Chemistry & industry
Suppliers4 total
2A PharmaChem USA[email protected]
Leancare Ltd.[email protected]
Lanospharma Laboratories Co.,Ltd13440048448 · [email protected]
3B Scientific Corporation[email protected]
Related reactions
15 records
Compound notes
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